2-[(2,3,4,5,6-pentamethylphenyl)carbonylamino]terephthalic acid

Systemtic Name: 2-[(2,3,4,5,6-pentamethylphenyl)carbonylamino]terephthalic acid Openeye Name: 2-[(2,3,4,5,6-pentamethylbenzoyl)amino]terephthalic acid CAS Name: 2-[[oxo-(2,3,4,5,6-pentamethylphenyl)methyl]amino]terephthalic acid IUPAC Name: 2-[(2,3,4,5,6-pentamethylbenzoyl)amino]terephthalic acid Traditional Name: 2-[(2,3,4,5,6-pentamethylbenzoyl)amino]terephthalic acid Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)C)C

InChI

InChI=1S/C20H21NO5/c1-9-10(2)12(4)17(13(5)11(9)3)18(22)21-16-8-14(19(23)24)6-7-15(16)20(25)26/h6-8H,1-5H3,(H,21,22)(H,23,24)(H,25,26)